Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.63 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.63 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.57 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | NOS1 | P29475 | 2/20 | 0.51 |
| ▸ | NOS2 | P35228 | 2/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | NOS3 | P29474 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10950517 | 0.84 | ACHE (0.54) | CHRNB2CHRNA4KEAP1NFE2L2NOS1 | |
| SCHEMBL10955368 | 0.83 | NOS1 (0.55) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL30862627 | 0.82 | CHRNB2 (0.67) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL5025139 | 0.82 | CHRNB2 (0.67) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL16858365 | 0.82 | CHRNB2 (0.67) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL26995599 | 0.82 | TAAR1 (0.58) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL781665 | 0.81 | KEAP1 (0.70) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL1641682 | 0.81 | CHRNB2 (0.65) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL11934997 | 0.80 | CHRNB2 (0.49) | CHRNB2CHRNA4KEAP1NFE2L2KDM4E | |
| SCHEMBL16718937 | 0.80 | MAPK1 (0.59) | ALDH1A1LMNASMN1; SMN2NOS1NOS2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4496567-A | HSITAMINE H2 ANTAGONISTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1985-01-29 | — | — | US | disclosed |
| EP-0013071-A1 | Pyrimidinone derivatives, processes for preparing them and pharmaceutical compositions containing them | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1980-07-09 | — | — | EP | disclosed |
| WO-1980000966-A1 | NEW HISTAMINE H2-ANTAGONISTS | SMITH KLINE FRENCH LAB (GB) | 1980-05-15 | — | — | WO | disclosed |